SCHEMBL30656165

SCHEMBL30656165

CCOC(=O)c1c(C)sc2ccc(OCc3scnc3C)cc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
MAPT P10636 6/20 0.40
LMNA P02545 2/20 0.40
MAPK1 P28482 2/20 0.40
KDM4E B2RXH2 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
HPGD P15428 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
HSP90AA1 P07900 1/20 0.39
TSHR P16473 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
HSD17B10 Q99714 2/20 0.39
HIF1A Q16665 1/20 0.39
POLB P06746 1/20 0.39
GABRA1 P14867 2/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
GABRA5 P31644 2/20 0.38
GABRA3 P34903 2/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL26661121 1.00 ALDH1A1 (0.40) ALDH1A1MAPTLMNAMAPK1KDM4E
SCHEMBL26661122 0.88 EDNRA (0.40) LMNAPOLBHTT
SCHEMBL30656161 0.88 EDNRA (0.40) LMNAPOLBHTT
SCHEMBL31350338 0.87 PARP10 (0.39) L3MBTL1NPC1RAB9APOLBSMN1; SMN2
SCHEMBL30656117 0.85 MEN1 (0.37) L3MBTL1TDP1
SCHEMBL26693511 0.81 ALDH1A1 (0.63) ALDH1A1MAPTLMNAMAPK1KDM4E
SCHEMBL30659921 0.81 ALDH1A1 (0.63) ALDH1A1MAPTLMNAMAPK1KDM4E
SCHEMBL30656128 0.80 EGLN2 (0.34) ALDH1A1L3MBTL1TDP1
SCHEMBL30656116 0.80 EGLN2 (0.35) L3MBTL1TDP1
SCHEMBL31351335 0.80 GABRA1 (0.55) ALDH1A1MAPTLMNAL3MBTL1HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4532013-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS Katholieke Universiteit Leuven KU Leuven Research & Development (BE) 2025-04-09 EP disclosed
CN-119421879-A Novel derivatives for the treatment of TRPM3 mediated disorders 勒芬天主教大学 2025-02-11 CN disclosed
WO-2023227697-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed